chempirical

3,5-Dibromobiphenyl

C12H8Br2CAS 16372-96-6312.00 g/mol

Open in Covalent MOL file
BrBr
Aryl halide

Properties

Molecular formula
C12H8Br2
Molar mass
312.00 g/mol
Exact mass
309.8993 Da
Density
1.7197 g/mL (at 25 °C)
Melting point
15 °C
Boiling point
208 °C (at 15 Torr)
logP
4.88Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Identifiers

CAS number
16372-96-6
SMILES
Brc1cc(Br)cc(-c2ccccc2)c1
InChIKey
HIHYAKDOWUFGBK-UHFFFAOYSA-N
InChI
InChI=1S/C12H8Br2/c13-11-6-10(7-12(14)8-11)9-4-2-1-3-5-9/h1-8H

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

4 names
  • 1,1′-Biphenyl, 3,5-dibromo-
  • Biphenyl, 3,5-dibromo-
  • 3,5-Dibromo-1,1′-biphenyl
  • PBB 14

Work with 3,5-Dibromobiphenyl

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Bromo-3,5-diphenylbenzene103068-20-889 % similar 4-Bromo-5′-phenyl-1,1′:3′,1′′-terphenyl116941-52-768 % similar 3-Bromobiphenyl2113-57-768 % similar 2-(3,5-Dibromophenyl)-4,6-diphenyl-1,3,5-triazine1073062-59-564 % similar 4-Bromobiphenyl92-66-062 % similar 1,3,5-Triphenylbenzene612-71-558 % similar Bromobenzene108-86-150 % similar Biphenyl92-52-450 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2,2′-Dibromobiphenyl13029-09-9 4,4′-Dibromobiphenyl92-86-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook